| SpectraBase Spectrum ID |
9FREgbD8TRi |
| Name |
Doxylamine-M (HO-carbinol) -H2O |
| Classification |
Antihistamine |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
197.084063977 u |
| Formula |
C13H11NO |
| InChI |
InChI=1S/C13H11NO/c1-10(13-4-2-3-9-14-13)11-5-7-12(15)8-6-11/h2-9,15H,1H2 |
| InChIKey |
PWZZJMMNHFFZCF-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
197.237 g/mol |
| SMILES |
c1ccnc(c1)C(c1ccc(cc1)O)=C |
| SPLASH |
splash10-0002-1900000000-82b6fbeabd72d473533d |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Sample Preparation Procedure |
Detected: UHY |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_2688 |
